2-[(E)-4-(4-heptylcyclohexyl)but-3-enyl]benzenecarbonitrile

Systemtic Name: 2-[(E)-4-(4-heptylcyclohexyl)but-3-enyl]benzenecarbonitrile Openeye Name: 2-[(E)-4-(4-heptylcyclohexyl)but-3-enyl]benzonitrile CAS Name: 2-[(E)-4-(4-heptylcyclohexyl)but-3-enyl]benzonitrile IUPAC Name: 2-[(E)-4-(4-heptylcyclohexyl)but-3-enyl]benzonitrile Traditional Name: 2-[(E)-4-(4-heptylcyclohexyl)but-3-enyl]benzonitrile Formula: C24H35N MolecularWeight: 337.5414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C=CCCC2=CC=CC=C2C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)/C=C/CCC2=CC=CC=C2C#N

InChI

InChI=1S/C24H35N/c1-2-3-4-5-6-11-21-16-18-22(19-17-21)12-7-8-13-23-14-9-10-15-24(23)20-25/h7,9-10,12,14-15,21-22H,2-6,8,11,13,16-19H2,1H3/b12-7+